4-bromophenyl 2-oxo-2H-1-benzopyran-3-carboxylate
Chemical Structure Depiction of
4-bromophenyl 2-oxo-2H-1-benzopyran-3-carboxylate
4-bromophenyl 2-oxo-2H-1-benzopyran-3-carboxylate
Compound characteristics
| Compound ID: | 8017-3190 |
| Compound Name: | 4-bromophenyl 2-oxo-2H-1-benzopyran-3-carboxylate |
| Molecular Weight: | 345.15 |
| Molecular Formula: | C16 H9 Br O4 |
| Smiles: | C1=C(C(=O)Oc2ccc(cc2)[Br])C(=O)Oc2ccccc12 |
| Stereo: | ACHIRAL |
| logP: | 3.9541 |
| logD: | 3.9541 |
| logSw: | -4.3966 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 41.538 |
| InChI Key: | YMKMEGRWKZZVJM-UHFFFAOYSA-N |